4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole
TL;DR: 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole (CAS 5243-91-4) is a chemical compound with molecular formula C11H13NS and molecular weight 191.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole
Also Known As: 4,5-dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole, Propanedioic acid,(cyclopentylmethyl), 2-Phenyl-4,5-dimethyl-2-thiazoline, 4,5-dimethyl-2-phenyl-4,5-dihydrothiazole, Thiazole,4,5-dihydro-4,5-dimethyl-2-phenyl-, trans- (9CI)
| Molecular Formula | C11H13NS |
|---|---|
| Molecular Weight | 191.08 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 37.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.07687 |
| Heavy Atoms | 13 |
| Complexity | 206.0 |
Chemical Identifiers
| CAS Number | 5243-91-4 |
|---|---|
| SMILES | CC1C(SC(=N1)C2=CC=CC=C2)C |
| InChIKey | DQSPCLCGGPBWGP-UHFFFAOYSA-N |
Product Overview
4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole (CAS 5243-91-4), with molecular formula C11H13NS and molecular weight 191.08 g/mol. IUPAC: 4,5-dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole.
Chemical Property Profile of 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole
Property Insights of 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole. With a topological polar surface area (TPSA) of 37.7 Ų, 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole?
The CAS number of 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole is 5243-91-4.
What is the molecular formula of 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole?
The molecular formula of 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole is C11H13NS.
What is the molecular weight of 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole?
The molecular weight of 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole is 191.08 g/mol.
Where can I buy 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole?
You can request a quote for 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dimethyl-2-phenyl-4,5-dihydro-1,3-thiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.